2-[4-phenyl-6-[2-(pyridin-2-ylamino)ethylcarbamoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[4-phenyl-6-[2-(pyridin-2-ylamino)ethylcarbamoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[4-phenyl-6-[2-(2-pyridylamino)ethylcarbamoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[6-[oxo-[2-(2-pyridinylamino)ethylamino]methyl]-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[4-phenyl-6-[2-(pyridin-2-ylamino)ethylcarbamoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[4-phenyl-6-[2-(2-pyridylamino)ethylcarbamoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]acetic acid Formula: C24H24N4O4 MolecularWeight: 432.47176

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1C3=CC=CC=C3)C=C(C=C2)C(=O)NCCNC4=CC=CC=N4)CC(=O)O

Isomeric SMILES

C1C(OC2=C(N1C3=CC=CC=C3)C=C(C=C2)C(=O)NCCNC4=CC=CC=N4)CC(=O)O

InChI

InChI=1S/C24H24N4O4/c29-23(30)15-19-16-28(18-6-2-1-3-7-18)20-14-17(9-10-21(20)32-19)24(31)27-13-12-26-22-8-4-5-11-25-22/h1-11,14,19H,12-13,15-16H2,(H,25,26)(H,27,31)(H,29,30)